SCHEMBL19412425

SCHEMBL19412425

C[C@H]1C[C@H](c2ccc3c(N)ncnn23)OC1(CO)CO

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ POLRMT O00411 1/20 0.36
▸ DOT1L Q8TEK3 5/20 0.35
▸ MAP4K4 O95819 1/20 0.31
▸ ACVRL1 P37023 1/20 0.30
▸ TNIK Q9UKE5 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL19412426 0.85 POLRMT (0.34) POLRMTDOT1L
SCHEMBL25401925 0.84 POLRMT (0.37) POLRMTDOT1LACVRL1
SCHEMBL17131349 0.84 POLRMT (0.35) POLRMTDOT1L
SCHEMBL19412761 0.83 POLRMT (0.38) POLRMTDOT1LMAP4K4ACVRL1
SCHEMBL17131348 0.82 POLRMT (0.34) POLRMTDOT1L
SCHEMBL17131357 0.82 STING1 (0.30) —
SCHEMBL17106816 0.81 POLRMT (0.34) POLRMTDOT1L
SCHEMBL17106802 0.81 POLRMT (0.34) POLRMTDOT1L
SCHEMBL26270281 0.81 POLRMT (0.38) POLRMTDOT1LMAP4K4ACVRL1
SCHEMBL17106845 0.78 POLRMT (0.37) POLRMTDOT1L

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180002366-A1 4'-SUBSTITUTED NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITORS MERCK SHARP & DOHME CORP. (US) 2018-01-04 — — US disclosed
US-9777035-B2 4′-substituted nucleoside reverse transcriptase inhibitors MERCK SHARP & DOHME CORP. (US) 2017-10-03 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20180002366-A1 4'-SUBSTITUTED NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITORS DUT, HPRT1, RNGTT POLRMT 7/4885DOT1L 799/4885MAP4K4 2037/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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